CID 56843270

26765-68-4

Structural Information

Molecular Formula
C17H16O
SMILES
C1CC2=C3C(=CC=C2)C4=CC=CC=C4C3(C1)CO
InChI
InChI=1S/C17H16O/c18-11-17-10-4-6-12-5-3-8-14(16(12)17)13-7-1-2-9-15(13)17/h1-3,5,7-9,18H,4,6,10-11H2
InChIKey
REEDTDAAIXYAOV-UHFFFAOYSA-N
Compound name
5,6-dihydro-4H-fluoranthen-6a-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.12012 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.12740 153.8
[M+Na]+ 259.10934 162.3
[M-H]- 235.11284 158.1
[M+NH4]+ 254.15394 178.1
[M+K]+ 275.08328 156.1
[M+H-H2O]+ 219.11738 147.4
[M+HCOO]- 281.11832 171.8
[M+CH3COO]- 295.13397 166.1
[M+Na-2H]- 257.09479 161.3
[M]+ 236.11957 153.1
[M]- 236.12067 153.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.